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4-HYDROXY-3-(3,7-DIMETHYL-1-OXO)-2(E),6-OCTADIENYLBENZOIC-ACID
SpectraBase Compound ID AQRzTufbsRh
InChI InChI=1S/C17H20O4/c1-11(2)5-4-6-12(3)9-16(19)14-10-13(17(20)21)7-8-15(14)18/h5,7-10,18H,4,6H2,1-3H3,(H,20,21)/b12-9+
InChIKey MPPGIWBJWPIEDY-FMIVXFBMSA-N
Mol Weight 288.34 g/mol
Molecular Formula C17H20O4
Exact Mass 288.136159 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AQTejvepAjL
Name 4-HYDROXY-3-(3,7-DIMETHYL-1-OXO)-2(E),6-OCTADIENYLBENZOIC-ACID
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20O4
InChI InChI=1S/C17H20O4/c1-11(2)5-4-6-12(3)9-16(19)14-10-13(17(20)21)7-8-15(14)18/h5,7-10,18H,4,6H2,1-3H3,(H,20,21)/b12-9+
InChIKey MPPGIWBJWPIEDY-FMIVXFBMSA-N
Literature Reference Author N.P.SEERAM,H.JACOBS,S.MCLEAN,W.F.REYNOLDS
Literature Reference Citation PHYTOCHEM.,43,863(1996)
Literature Reference DOI 10.1016/0031-9422(96)00295-6
Molecular Weight 288.343 g/mol
Solvent CDCl3
Source File Reference UWMS2220